SCHEMBL29176133

SCHEMBL29176133

CC(C)=CCCc1cccc(P)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 2/20 0.35
▸ CNR2 P34972 1/20 0.34
▸ NOS1 P29475 1/20 0.33
▸ PLA2G4A P47712 1/20 0.33
▸ GGPS1 O95749 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27499784 0.80 DRD2 (0.53) —
SCHEMBL105976 0.77 TRPV1 (0.51) TRPV1
SCHEMBL29176132 0.76 TRPV1 (0.37) TRPV1CNR2NOS1PLA2G4AGGPS1
SCHEMBL29176142 0.75 TRPV1 (0.36) TRPV1CNR2NOS1PLA2G4AGGPS1
SCHEMBL26343229 0.73 ALDH1A1 (0.37) NOS1
SCHEMBL3084716 0.72 PTPN1 (0.52) TRPV1CNR2GGPS1PPARGPPARA
SCHEMBL3084710 0.72 PTPN1 (0.52) TRPV1CNR2GGPS1PPARGPPARA
SCHEMBL12653031 0.72 CLK4 (0.41) —
SCHEMBL3090448 0.72 PTPN1 (0.52) TRPV1CNR2GGPS1PPARGPPARA
SCHEMBL3090445 0.72 PTPN1 (0.52) TRPV1CNR2GGPS1PPARGPPARA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113474388-B Method for converting phenyl isocyanate 陶氏环球技术有限责任公司 2024-03-22 — — CN disclosed
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